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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > steroid > anthenoside a
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > anthenoside a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > anthenoside a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > anthenoside a
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > anthenoside a

Preferred term

anthenoside a  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C38H65NO9

has_parent_hydride

inchi

  • InChI=1S/C38H65NO9/c1-9-22(19(2)3)11-10-20(4)30-27(47-36-31(39-21(5)41)34(45)35(46-8)28(18-40)48-36)17-25-29-24(13-15-38(25,30)7)37(6)14-12-23(42)16-26(37)32(43)33(29)44/h19-20,22-24,26-28,30-36,40,42-45H,9-18H2,1-8H3,(H,39,41)/t20-,22-,23+,24+,26-,27-,28?,30+,31+,32+,33-,34?,35+,36-,37-,38+/m1/s1

inchikey

  • RNKLRQYEPYNQHD-NSMQWETHSA-N

mass

  • 679.936

monoisotopicmass

  • 679.46593

smiles

  • O([C@H]1[C@@]([C@@]2(C(=C3[C@@]([C@@]4([C@@]([C@H](O)[C@@H]3O)(C[C@@H](O)CC4)[H])C)(CC2)[H])C1)C)([C@@H](CC[C@H](C(C)C)CC)C)[H])[C@@H]5OC([C@H](OC)C(O)[C@@H]5NC(=O)C)CO

subset

  • 2_STAR

synonym EXACT

  • N-[(2R,3S,5R)-2-[[(3S,5S,6S,7R,9R,10R,13R,16R,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-3,6,7-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-16-yl]oxy]-4-hydroxy-6-(hydroxymethyl)-5-methoxyoxan-3-yl]acetamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:183128

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