Name: Sarasinoside B1
Rating: 5 (10 reviews)

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HIT ID:HIT214320498
Cas No:114066-50-1
常用名:Sarasinoside B1
别名:Sarasinoside-B1
IUPAC:N-{2-[(6-{[6,6,9a,11a-tetramethyl-1-(6-methyl-4-oxohept-5-en-2-yl)-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl]oxy}-5-[(6-{[(4,5-dihydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]methyl}-3-acetamido-4,5-dihydroxyoxan-2-yl)oxy]-4-hydroxyoxan-3-yl)oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl}acetamide
IUPAC:N-{2-[(6-{[6,6,9a,11a-tetramethyl-1-(6-methyl-4-oxohept-5-en-2-yl)-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl]oxy}-5-[(6-{[(4,5-dihydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]methyl}-3-acetamido-4,5-dihydroxyoxan-2-yl)oxy]-4-hydroxyoxan-3-yl)oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl}acetamide
InChI key:RLZMJVGFNSVJOP-UHFFFAOYSA-N

分子式:C61H98N2O25
分子量:1259.444
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[#6]-[#6](-[#6]-[#6](=O)\[#6]=[#6](\[#6])-[#6])-[#6]1-[#6]-[#6]-[#6]2-[#6]-3=[#6](-[#6]-[#6]C12[#6])C1([#6])[#6]-[#6]-[#6](-[#8]-[#6]-2-[#8]-[#6]-[#6](-[#8]-[#6]-4-[#8]-[#6](-[#6]-[#8])-[#6](-[#8])-[#6](-[#8])-[#6]-4-[#7]-[#6](-[#6])=O)-[#6](-[#8])-[#6]-2-[#8]-[#6]-2-[#8]-[#6](-[#6]-[#8]-[#6]-4-[#8]-[#6]-[#6](-[#8])-[#6](-[#8])-[#6]-4-[#8]-[#6]-4-[#8]-[#6](-[#6]-[#8])-[#6](-[#8])-[#6](-[#8])-[#6]-4-[#8])-[#6](-[#8])-[#6](-[#8])-[#6]-2-[#7]-[#6](-[#6])=O)C([#6])([#6])[#6]1-[#6]-[#6]-3 |c:13|
SMILES:[#6]-[#6](-[#6]-[#6](=O)\[#6]=[#6](\[#6])-[#6])-[#6]1-[#6]-[#6]-[#6]2-[#6]-3=[#6](-[#6]-[#6]C12[#6])C1([#6])[#6]-[#6]-[#6](-[#8]-[#6]-2-[#8]-[#6]-[#6](-[#8]-[#6]-4-[#8]-[#6](-[#6]-[#8])-[#6](-[#8])-[#6](-[#8])-[#6]-4-[#7]-[#6](-[#6])=O)-[#6](-[#8])-[#6]-2-[#8]-[#6]-2-[#8]-[#6](-[#6]-[#8]-[#6]-4-[#8]-[#6]-[#6](-[#8])-[#6](-[#8])-[#6]-4-[#8]-[#6]-4-[#8]-[#6](-[#6]-[#8])-[#6](-[#8])-[#6](-[#8])-[#6]-4-[#8])-[#6](-[#8])-[#6](-[#8])-[#6]-2-[#7]-[#6](-[#6])=O)C([#6])([#6])[#6]1-[#6]-[#6]-3 |c:13|

Sarasinoside B1 is a norlanostane-triterpenoid oligoglycoside from the Palauan marine sponge Asteropus sarasinosum.

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