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3.beta.,13-Dihydroxyurs-11-en-28-oic acid .gamma.-lactone
SpectraBase Compound ID AC6QVAQQhPz
InChI InChI=1S/C30H46O3/c1-18-8-14-29-17-16-28(7)27(6)13-9-20-25(3,4)22(31)11-12-26(20,5)21(27)10-15-30(28,33-24(29)32)23(29)19(18)2/h10,15,18-23,31H,8-9,11-14,16-17H2,1-7H3/t18-,19+,20-,21?,22+,23-,26+,27-,28+,29+,30+/m1/s1
InChIKey UVBLDLGZDSGCSN-YDQBLQJNSA-N
Mol Weight 454.7 g/mol
Molecular Formula C30H46O3
Exact Mass 454.344695 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BWb99iKSux6
Name 3.beta.,13-Dihydroxyurs-11-en-28-oic acid .gamma.-lactone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H46O3
InChI InChI=1S/C30H46O3/c1-18-8-14-29-17-16-28(7)27(6)13-9-20-25(3,4)22(31)11-12-26(20,5)21(27)10-15-30(28,33-24(29)32)23(29)19(18)2/h10,15,18-23,31H,8-9,11-14,16-17H2,1-7H3/t18-,19+,20-,21?,22+,23-,26+,27-,28+,29+,30+/m1/s1
InChIKey UVBLDLGZDSGCSN-YDQBLQJNSA-N
Molecular Weight 454.695 g/mol
SMILES O[C@]1(CC[C@@]2(C3C=C[C@]45[C@]([C@@]3(CC[C@@]2(C1(C)C)[H])C)(CC[C@@]1([C@]5([C@]([C@@](CC1)(C)[H])(C)[H])[H])C(O4)=O)C)C)[H]
SPLASH splash10-0ik9-0020900000-9396b0194245e3ec98e2
Source of Spectrum F-50-11482-20
Synonyms (1S,4S,5R,10S,13S,17S,19S,20R)-10-hydroxy-4,5,9,9,13,19,20-heptamethyl-24-oxahexacyclo[15.5.2.0(1,18).0(4,17).0(5,14).0(8,13)]tetracos-15-en-23-one
Wiley ID 789478