2-hydroxy-(22-27)-hexanorcucurbita-1,5,16-triene-3,11,20-trione 2-O-beta-D-glucopyranoside (Q27137270)

CHEBI:68915 (English)

7 October 2016

chemical formula

C₃₀H₄₀O₉

1 reference

CHEBI:68915 (English)

7 October 2016

canonical SMILES

CC(=O)C1=CCC2(C1(CC(=O)C3(C2CC=C4C3C=C(C(=O)C4(C)C)OC5C(C(C(C(O5)CO)O)O)O)C)C)C

1 reference

CHEBI:68915 (English)

7 October 2016

isomeric SMILES

CC(=O)C1=CC[C@@]2([C@@]1(CC(=O)[C@@]3([C@H]2CC=C4[C@H]3C=C(C(=O)C4(C)C)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)C)C)C

1 reference

Cucurbitane glucosides from the root of Machilus yaoshansis

CHEBI:68915 (English)

7 October 2016

1 reference

Identifiers

InChI

InChI=1S/C30H40O9/c1-14(32)15-9-10-28(4)20-8-7-16-17(30(20,6)21(33)12-29(15,28)5)11-18(25(37)27(16,2)3)38-26-24(36)23(35)22(34)19(13-31)39-26/h7,9,11,17,19-20,22-24,26,31,34-36H,8,10,12-13H2,1-6H3/t17-,19-,20+,22-,23+,24-,26-,28+,29-,30+/m1/s1

1 reference

CHEBI:68915 (English)

IWCKWAIXWURPAN-SQXHYVSRSA-N

7 October 2016

InChIKey

2 references

CHEBI:68915 (English)

7 October 2016

stated in

ChEBI release 2020-09-01

2 references

2-hydroxy-(22-27)-hexanorcucurbita-1,5,16-triene-3,11,20-trione 2-O-beta-D-glucopyranoside (English)

IWCKWAIXWURPAN-SQXHYVSRSA-N

7 October 2016

InChIKey

8 April 2021

https://commonchemistry.cas.org/detail?cas_rn=1345690-60-9

1 reference

(4R,9beta)-9,10,14-Trimethyl-1,11,20-trioxo-4,9-cyclo-9,10-secopregna-2,5,16-trien-2-yl beta-D-glucopyranoside (English)

7 October 2016

1 reference

CHEBI:68915 (English)

7 October 2016

Reaxys registry number

22123599

1 reference

2-hydroxy-(22-27)-hexanorcucurbita-1,5,16-triene-3,11,20-trione 2-O-beta-D-glucopyranoside (English)

7 October 2016

ChEBI ID

68915

mapping relation type

1 reference

2-hydroxy-(22-27)-hexanorcucurbita-1,5,16-triene-3,11,20-trione 2-O-beta-D-glucopyranoside (English)

7 October 2016

1 reference