ID: 120058
SMILES:CC(O)(C)C1Cc2c(c(O)ccc2O)C(OCC=C(CCC=C(C)C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.714
InChIKey:ASEHLVOUKDBADA-UHFFFAOYSA-N
ID: 120059
SMILES:C1=C(C)CCC(C(C)C)C(c2c(O)cc(CCC)cc2O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 302.458
CB1 binding score: -17.605
InChIKey:MGNLBYJFJYZIJY-UHFFFAOYSA-N
ID: 120060
SMILES:C12(C)CC3c4cc(O)cc(C)c4OC(C)(C)C1C3C(=O)C1C(C)=C3C(=CC4C2C1C4)CC(C)C3O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.641
CB1 binding score: -15.519
InChIKey:USYOZYJYXMIWTC-UHFFFAOYSA-N
ID: 120061
SMILES:C(C)(C1c2c(O)c3c(cc2O)OC(C)(C)C(O)C3)c(C(C)(C)C)cc(O)c1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.476
CB1 binding score: -16.746
InChIKey:ATUINAGNIDYPBV-UHFFFAOYSA-N
ID: 120062
SMILES:c12c(cc(CC(C)C(=NCCCS(=O)(=O)C)OC)o1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 437.602
CB1 binding score: -16.521
InChIKey:LNSFTBNKUCWFQP-UHFFFAOYSA-N
ID: 120063
SMILES:C1(C)CCCC(C)(C)C1c1c(O)cc(CCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.42
CB1 binding score: -16.514
InChIKey:LDTSVWQQCCKUTD-UHFFFAOYSA-N
ID: 120064
SMILES:C1=CC2(C)Oc3cc(C)cc(O)c3C2C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.291
CB1 binding score: -15.376
InChIKey:UDXQAHZPWGMRMI-UHFFFAOYSA-N
ID: 120065
SMILES:C1(CO)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 120066
SMILES:C=C(C)C1CCC(O)(C)C2Oc3cc(CCCC)cc(O)c3C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.426
InChIKey:FCEHNVUSBXPIAZ-UHFFFAOYSA-N
ID: 120067
SMILES:C=C(C)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 120068
SMILES:C1C(C(=C)C)C(c2c(O)cc(CCCCC)cc2OC)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.696
InChIKey:HYNYRWBHLSVRRM-UHFFFAOYSA-N
ID: 120069
SMILES:CC1(C)Oc2c(OC(C)=O)cc(C)c(OC)c2C2C=C(C)CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.889
InChIKey:XOEVCERSPOXCQH-UHFFFAOYSA-N
ID: 120070
SMILES:c12c(O)cc(CCC)cc1OC1(C)C(C2)C(C)(C)C(=O)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -15.598
InChIKey:ZDOINJUTEBXYNO-UHFFFAOYSA-N
ID: 120071
SMILES:C(c1cc2c(cc1)OC(CO)(C)C1C2CC(C)(O)CC1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -13.687
InChIKey:WWAXVUWOMKVNFT-UHFFFAOYSA-N
ID: 120072
SMILES:CC(=CCc1c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C)CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.589
CB1 binding score: -16.96
InChIKey:OILRBKLLZDECGD-UHFFFAOYSA-N
ID: 120073
SMILES:C12C(C(CO)CCC1C(C)C)Oc1c(c(O)cc(CCCCC)c1)C2CC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -15.706
InChIKey:JZRIFRMBIZZXTA-UHFFFAOYSA-N
ID: 120074
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C3C(C)(C)C(=O)CCC12C(CC(C)=O)CC3(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: Not available
InChIKey:KWQISGMMZZCBIE-UHFFFAOYSA-N
ID: 120075
SMILES:C12CCC(C)=CC1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 120076
SMILES:O1C(C(C)(O)CO)CCC1C1CCC(O)(C)C2Oc3cc(CCCCC)cc(O)c3C21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.573
CB1 binding score: -12.326
InChIKey:ZOVXTJOWGJBKKF-UHFFFAOYSA-N
ID: 120077
SMILES:C1(C)=CC2C(C(C)(C)Oc3cc(CCc4ccccc4)cc(O)c32)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.486
CB1 binding score: -19.258
InChIKey:DYHMKBLKWFFFSZ-UHFFFAOYSA-N
ID: 120078
SMILES:CCC(c1cc(CC(C)C)c(O)c(C2C=C(C)CCC2C(C)=C)c1O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -15.032
InChIKey:DKEJHHLBCITPFS-UHFFFAOYSA-N