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Merck
CN

H4274

Hecogenin acetate

≥90%

Synonym(s):

(−)-Hecogenin acetate

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About This Item

Empirical Formula (Hill Notation):
C29H44O5
CAS Number:
915-35-5
Molecular Weight:
472.66
NACRES:
NA.25
PubChem Substance ID:
24895633
UNSPSC Code:
12352200
EC Number:
213-021-7
MDL number:
MFCD00005088

Key Documents

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InChI

1S/C29H44O5/c1-16-8-11-29(32-15-16)17(2)26-24(34-29)13-23-21-7-6-19-12-20(33-18(3)30)9-10-27(19,4)22(21)14-25(31)28(23,26)5/h16-17,19-24,26H,6-15H2,1-5H3/t16-,17+,19+,20+,21-,22+,23+,24+,26+,27+,28-,29-/m1/s1

InChI key

CVKZWRTYHCDWTE-RSEFXUKDSA-N

SMILES string

[H][C@@]12CC[C@]3([H])[C@]([H])(CC(=O)[C@@]4(C)[C@@]3([H])C[C@]5([H])O[C@]6(CC[C@@H](C)CO6)[C@@H](C)[C@]45[H])[C@@]1(C)CC[C@@H](C2)OC(C)=O

assay

≥90%

mp

246-248 °C (dec.) (lit.)

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Storage Class

13 - Non Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
MKCF4986
MKCC8198
MKBW6202V
MKBR4442V
SLBD2271V

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Azzurra Santoro et al.
Parasitology, 1-7 (2018-08-09)
We investigated the molecular epidemiology of Cryptosporidium spp. in Estonia by testing fecal samples from 486 calves aged <2 months, raised on 53 cattle farms, for the presence of Cryptosporidium DNA. The parasites were identified and characterized by sequencing of
Dan-Dan Tian et al.
Drug metabolism and disposition: the biological fate of chemicals, 47(7), 724-731 (2019-04-28)
Midazolam is a widely used index substrate for assessing effects of xenobiotics on CYP3A activity. A previous study involving human hepatocytes showed the primary route of midazolam metabolism, 1'-hydroxylation, shifted to N-glucuronidation in the presence of the CYP3A inhibitor ketoconazole
Jullyana S S Quintans et al.
Molecules (Basel, Switzerland), 19(6), 8303-8316 (2014-06-21)
Hecogenin is a steroidal sapogenin largely drawn from the plants of the genus Agave, commonly known as 'sisal', and is one of the important precursors used by the pharmaceutical industry for the synthesis of steroid hormones. Hecogenin acetate (HA) is

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