Olean-12-en-28-oicacid, 3-(b-D-glucopyranosyloxy)-,O-6-deoxy-a-L-mannopyranosyl-(1(R)6)-O-[b-D-glucopyranosyl-(1(R)2)]-b-D-glucopyranosyl ester, (3b)- (9CI)
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![Olean-12-en-28-oicacid, 3-(b-D-glucopyranosyloxy)-,O-6-deoxy-a-L-mannopyranosyl-(1(R)6)-O-[b-D-glucopyranosyl-(1(R)2)]-b-D-glucopyranosyl ester, (3b)- (9CI) structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/7a25fa4c7c094585abd68bc6264c44c5.png "Olean-12-en-28-oicacid, 3-(b-D-glucopyranosyloxy)-,O-6-deoxy-a-L-mannopyranosyl-(1(R)6)-O-[b-D-glucopyranosyl-(1(R)2)]-b-D-glucopyranosyl ester, (3b)- (9CI)")
Olean-12-en-28-oicacid, 3-(b-D-glucopyranosyloxy)-,O-6-deoxy-a-L-mannopyranosyl-(1(R)6)-O-[b-D-glucopyranosyl-(1(R)2)]-b-D-glucopyranosyl ester, (3b)- (9CI)
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CAS No:
129932-83-8
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Formula:
C54H88O22
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Chemical Name:
Olean-12-en-28-oicacid, 3-(b-D-glucopyranosyloxy)-,O-6-deoxy-a-L-mannopyranosyl-(1(R)6)-O-[b-D-glucopyranosyl-(1(R)2)]-b-D-glucopyranosyl ester, (3b)- (9CI)
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Synonyms:
Clemontanoside B;129932-83-8;Olean-12-en-28-oic acid, 3-(beta-D-glucopyranosyloxy)-, O-6-deoxy-alpha-L-mannopyranosyl-(1-6)-O-(beta-D-glucopyranosyl-(1-2))-beta-D-glucopyranosyl ester, (3beta)-
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CAS No:
Olean-12-en-28-oicacid, 3-(b-D-glucopyranosyloxy)-,O-6-deoxy-a-L-mannopyranosyl-(1(R)6)-O-[b-D-glucopyranosyl-(1(R)2)]-b-D-glucopyranosyl ester, (3b)- (9CI) Basic Attributes
1089.3 g/mol
1088.57672443 g/mol
Computed Properties
Molecular Weight:1089.3
XLogP3:0.8
Hydrogen Bond Donor Count:13
Hydrogen Bond Acceptor Count:22
Rotatable Bond Count:12
Exact Mass:1088.57672443
Monoisotopic Mass:1088.57672443
Topological Polar Surface Area:354
Heavy Atom Count:76
Complexity:2100
Undefined Atom Stereocenter Count:28
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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