Vitas-M small molecule compound

5,6,6',7,12-pentamethoxy-2-methyl-1',2'-didehydroberbaman

Catalog ID
STL565319
SMILES COc1ccc2cc1Oc1ccc(cc1)CC1=NCCc3c1cc(Oc1c4[C@@H](C2)N(C)CCc4c(c(c1OC)OC)OC)c(OC)c3

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C38H40N2O7 MW 636.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H40N2O7/c1-40-16-14-26-34-29(40)18-23-9-12-30(41-2)32(19-23)46-25-10-7-22(8-11-25)17-28-27-21-33(31(42-3)20-24(27)13-15-39-28)47-36(34)38(45-6)37(44-5)35(26)43-4/h7-12,19-21,29H,13-18H2,1-6H3/t29-/m1/s1
InChIKey
YWNUNVSMOKMJMG-GDLZYMKVSA-N
Synonyms

(14R)919202125pentamethoxy15methyl723dioxa1530diazaheptacyclo(22622^(36)1^(812)1^(1418)0^(2731)0^(2233))hexatriaconta1(30)3581012(34)18(33)192124(32)2527(31)35tridecaenenitricacid
(14R)919202125pentamethoxy15methyl723dioxa1530diazaheptacyclo(22622361812114180273102233)hexatriaconta1(30)3(36)46(35)81012(34)18(33)1921242631tridecaene
(O)(N+)(=O)OCOc1ccc2cc1Oc1ccc(cc1)CC1=NCCc3c1cc(Oc1c4(C@@H)(C2)N(C)CCc4c(c(c1OC)OC)OC)c(OC)c3
16396622
566712pentamethoxy2methyl12didehydroberbaman
InChI=1SC38H40N2O7c1401614263429(40)182391230(412)32(1923)462510722(81125)1728272133(31(423)2024(27)13153928)4736(34)38(456)37(445)35(26)434h712192129H1318H216H3t29m1s1
ZINC000070669977

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Available files

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