ID: 31564
SMILES:Oc1c2c(cc(C)c1)OC(CC(CC)C)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -15.08
InChIKey:XLIQHNYHDAZXIC-UHFFFAOYSA-N
ID: 31565
SMILES:CCC(CCC(C)=CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)CC1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.631
CB1 binding score: -15.28
InChIKey:QZCAZODELGGDSC-UHFFFAOYSA-N
ID: 31566
SMILES:C1(C)(C)Oc2cc(C)c(OC)cc2C2CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 218.296
CB1 binding score: -18.539
InChIKey:HKMXBQRXEVSGLW-UHFFFAOYSA-N
ID: 31567
SMILES:C1=C(C)CC2C(C(C)(C)Oc3c(O)cc(CCCCC)cc32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.779
InChIKey:ZSDJPGLYWNHCIW-UHFFFAOYSA-N
ID: 31568
SMILES:c1c(C=O)c2c(cc1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -17.206
InChIKey:CCHKXRXFFFJJRQ-UHFFFAOYSA-N
ID: 31569
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(CCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 31570
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(CCc4cccc(O)c4)cc(O)c3C12
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 364.485
CB1 binding score: -16.591
InChIKey:NMXKDIUBEUGJJQ-UHFFFAOYSA-N
ID: 31571
SMILES:Oc1c(CC2C(C)=CCCC2(C)C)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -16.309
InChIKey:BUHPQZIWFXVJGG-UHFFFAOYSA-N
ID: 31572
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C(=O)CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -17.265
InChIKey:UHYZTDVYVAOZRR-UHFFFAOYSA-N
ID: 31573
SMILES:c1c2c(cc(C)c1O)OC1(C)C3C(C2O1)C(C)(CCC(C(C)(C)O)O)C(C)CC3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -16.453
InChIKey:WSEKEUOAHOFAKO-UHFFFAOYSA-N
ID: 31574
SMILES:CC(=CCC1OC1(C)C)CCc1c(O)c(C)cc(OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -16.81
InChIKey:PLGVGRYZPCQSQI-UHFFFAOYSA-N
ID: 31575
SMILES:C1(C)(C)Oc2cc(CCCCC)ccc2C2C1CCC1(C)C(CC2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -14.463
InChIKey:KKPSUXYXJDVILO-UHFFFAOYSA-N
ID: 31576
SMILES:C(C(=C)C)c1cc(C(=O)C)c(O)c2c1OC(C)(C)C1CCC(O)(C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -13.796
InChIKey:HVPGZXAPIXHBGD-UHFFFAOYSA-N
ID: 31577
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.957
InChIKey:OANGEIYPAQYPQV-UHFFFAOYSA-N
ID: 31578
SMILES:C1C(c2c(O)cc(CCCCC)cc2O)OC(CCC=C(CCC=C(C)C)C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.63
CB1 binding score: -16.485
InChIKey:DCTXKLSSWDUZGT-UHFFFAOYSA-N
ID: 31579
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(C)(OC)CC2)CCC1=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.525
InChIKey:OKVDZKCQYVXWGU-UHFFFAOYSA-N
ID: 31580
SMILES:C(C)=C(C)C(=O)Oc1ccc(CCCCC)cc1OC1(C(=C)C)CC=C(CCC=C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.69
CB1 binding score: -15.647
InChIKey:YLHNSJQBBNMSGX-UHFFFAOYSA-N
ID: 31581
SMILES:CCCCCc1cc2c(c(O)c1)C1CC(C)(O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 31582
SMILES:C12(C)C(CCC3(C)C1c1c(cc(CCCCC)c(O)c1OC(C)=O)O3)OC(C)(C)C(=O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.595
CB1 binding score: -12.872
InChIKey:SCLKMGWMDDHBJP-UHFFFAOYSA-N
ID: 31583
SMILES:c1(CCCC)c(O)c(C2C=C(C)CCC2C(C)=C)c(O)c(C=O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.073
InChIKey:YIEGRPUXIBZZKS-UHFFFAOYSA-N
ID: 31584
SMILES:CC1(O)C=C(C)CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C2C=C(C(=O)O2)CCC1C(C)(C)OC(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 568.751
CB1 binding score: -15.22
InChIKey:DJCQVBFQBFKWSL-UHFFFAOYSA-N