(Q115971670)

English

[(2S,8S,9R,10R,13R,14S,16R,17R)-17-[(2R)-6-acetyloxy-2-hydroxy-6-methyl-3-oxoheptan-2-yl]-16-benzoyloxy-4,4,9,13,14-pentamethyl-3,11-dioxo-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-2-yl] benzoate

chemical compound

In more languages

default values for all languages

No label defined

No description defined

edit

Statements

instance of

type of chemical entity

0 references

subclass of

cucurbitane triterpenoid

1 reference

based on heuristic

inferred from SMILES

mass

768.387347992 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₄₆H₅₆O₁₀

0 references

canonical SMILES

O=C(OC1C(=O)C(C2=CCC3C(C(=O)CC4(C)C(C(OC(=O)C=5C=CC=CC5)CC34C)C(O)(C(=O)CCC(OC(=O)C)(C)C)C)(C)C2C1)(C)C)C=6C=CC=CC6

0 references

isomeric SMILES

CC(=O)OC(C)(C)CCC(=O)[C@](C)(O)[C@H]1[C@H](OC(=O)c2ccccc2)C[C@@]2(C)[C@@H]3CC=C4[C@@H](C[C@H](OC(=O)c5ccccc5)C(=O)C4(C)C)[C@]3(C)C(=O)C[C@]12C

0 references

found in taxon

Trichosanthes cucumeroides

1 reference

stated in

Lipid-Lowering Activities of Cucurbitacins Isolated from Trichosanthes cucumeroides and Their Synthetic Derivatives

Identifiers

InChI

InChI=1S/C46H56O10/c1-27(47)56-41(2,3)23-22-35(48)46(9,53)37-33(55-40(52)29-18-14-11-15-19-29)25-43(6)34-21-20-30-31(45(34,8)36(49)26-44(37,43)7)24-32(38(50)42(30,4)5)54-39(51)28-16-12-10-13-17-28/h10-20,31-34,37,53H,21-26H2,1-9H3/t31-,32+,33-,34+,37+,43+,44-,45+,46+/m1/s1

0 references

InChIKey

QJGNRYWGVJQZJG-QOVOSSLOSA-N

0 references

2 references

3 January 2023

inferred from InChIKey

matched by identifier from

InChIKey

QJGNRYWGVJQZJG-QOVOSSLOSA-N

(Q115971670)

[(2S,8S,9R,10R,13R,14S,16R,17R)-17-[(2R)-6-acetyloxy-2-hydroxy-6-methyl-3-oxoheptan-2-yl]-16-benzoyloxy-4,4,9,13,14-pentamethyl-3,11-dioxo-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-2-yl] benzoate

Statements

Identifiers

Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)