Vitas-M small molecule compound

(4S,6R,7R,11Z)-4-hydroxy-4-[(1S)-1-hydroxyethyl]-6,7,14-trimethyl-3,8,17-trioxo-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-en-7-yl acetate

Catalog ID
STL564973
SMILES CN1CCC2OC(=O)[C@](O)(C[C@H]([C@@](C(=O)OCC(=CC1)C2=O)(C)OC(=O)C)C)[C@@H](O)C

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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 C21H31NO9 MW 441.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H31NO9/c1-12-10-21(28,13(2)23)19(27)30-16-7-9-22(5)8-6-15(17(16)25)11-29-18(26)20(12,4)31-14(3)24/h6,12-13,16,23,28H,7-11H2,1-5H3/b15-6-/t12-,13+,16?,20-,21+/m1/s1
InChIKey
MPJBVZKNLCGQHF-OXDPSKHNSA-N
Synonyms

((4S6R7R11Z)4hydroxy4((1S)1hydroxyethyl)6714trimethyl3817trioxo29dioxa14azabicyclo(951)heptadec11en7yl)acetate
(1R4S6R7RZ)4hydroxy4((R)1hydroxyethyl)6714trimethyl3817trioxo29dioxa14azabicyclo(951)heptadec11en7ylacetate
(4S6R7R11Z)4hydroxy4((1S)1hydroxyethyl)6714trimethyl3817trioxo29dioxa14azabicyclo(951)heptadec11en7ylacetate
139291965
CN1CC(C@H)2OC(=O)(C@)(O)(C(C@H)((C@@)(C(=O)OCC(=CC1)C2=O)(C)OC(=O)C)C)(C@H)(O)C
FLORIDANINE
InChI=1SC21H31NO9c1121021(2813(2)23)19(27)30167922(5)8615(17(16)25)112918(26)20(124)3114(3)24h61213162328H711H215H3b156t1213+16?2021+m1s1
MFCD32651621
ZINC000015956029

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Available files

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