Screening compound: MFCD00808494

Screening compound: MFCD00808494
Screening compound: MFCD00808494 alternative view

Chemical Structure Depiction of ChemDiv screening compound
MFCD00808494

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

N016-0020

Molecular Formula

C70H105N3O24S3 (C70 H105 N3 O24 S3)

Compound Name

methyl 2-[(10-{[4,5-bis(acetyloxy)-6-{[1-methoxy-4-(methylsulfanyl)-1-oxobutan-2-yl]carbamoyl}-3-{[3,4,5-tris(acetyloxy)-6-{[1-methoxy-4-(methylsulfanyl)-1-oxobutan-2-yl]carbamoyl}oxan-2-yl]oxy}oxan-2-yl]oxy}-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicen-2-yl)formamido]-4-(methylsulfanyl)butanoate

IUPAC name

methyl 2-{[(2S4aS6aS6bR12aS)-10-{[45-bis(acetyloxy)-6-{[1-methoxy-4-(methylsulfanyl)-1-oxobutan-2-yl]carbamoyl}-3-{[345-tris(acetyloxy)-6-{[1-methoxy-4-(methylsulfanyl)-1-oxobutan-2-yl]carbamoyl}oxan-2-yl]oxy}oxan-2-yl]oxy}-24a6a6b9912a-heptamethyl-13-oxo-12344a566a6b788a910111212a12b1314b-icosahydropicen-2-yl]formamido}-4-(methylsulfanyl)butanoate

SMILES

CC(C)(C(CC[C@@]1(C)[C@](C)(CC[C@@](C)(CC2)C3C[C@@]2(C)C(NC(CCSC)C(OC)=O)=O)C3=C2)[C@](C)(CC3)C1C2=O)C3OC(C(C(C1OC(C)=O)OC(C)=O)OC(C(C(C2OC(C)=O)OC(C)=O)OC(C)=O)OC2C(NC(CCSC)C(OC)=O)=O)OC1C(NC(CCSC)C(OC)=O)=O

InChI

InChI=1S/C70H105N3O24S3/c1-35(74)89-48-50(91-37(3)76)54(93-39(5)78)63(96-53(48)58(81)72-43(22-31-99-17)60(83)87-14)97-55-51(92-38(4)77)49(90-36(2)75)52(57(80)71-42(21-30-98-16)59(82)86-13)95-62(55)94-47-20-24-68(10)46(65(47,6)7)19-25-70(12)56(68)45(79)33-40-41-34-67(9,27-26-66(41,8)28-29-69(40,70)11)64(85)73-44(23-32-100-18)61(84)88-15/h33,41-44,46-56,62-63H,19-32,34H2,1-18H3,(H,71,80)(H,72,81)(H,73,85)/t41?,42?,43?,44?,46?,47?,48?,49?,50?,51?,52?,53?,54?,55?,56?,62?,63?,66-,67+,68+,69-,70-/m1/s1

InChI Key

QVMMRINATLSFTK-XASREQHBSA-N

MDL Number (MFCD)

MFCD00808494

MFCD00808494 in Drug Discovery

Included in Screening Libraries

Natural Compounds Library (353 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with MFCD00808494 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound MFCD00808494?
Check Price and Availability of MFCD00808494, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of MFCD00808494 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for MFCD00808494
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for MFCD00808494
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of MFCD00808494 available by request