ID: 96433
SMILES:Cc1c(C2C(C(C)C)CCC(O)(C)C2)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 332.528
CB1 binding score: -12.984
InChIKey:RWZLWSAPKALPQX-UHFFFAOYSA-N
ID: 96434
SMILES:C(CCCO)c1cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.578
InChIKey:VWFFDRSNKWHXJK-UHFFFAOYSA-N
ID: 96435
SMILES:C(=Cc1ccccc1)C(Oc1cc(CCCCC)ccc1C1C=C(C)CCC1C(C)C)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.632
CB1 binding score: -16.502
InChIKey:PRYWYMROBOBPCC-UHFFFAOYSA-N
ID: 96436
SMILES:O1c2c(ccc(OCC(=O)C(C)C)c2)C2C=C(C)CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.077
InChIKey:ANEWYSUELQSTEM-UHFFFAOYSA-N
ID: 96437
SMILES:C(=CC1(C)C2C3C(C)(Oc4c(C(=O)CCCCCCC)c(CCCCC)cc(O)c42)CCC1O3)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 536.797
CB1 binding score: -17.005
InChIKey:GDABGXPFWHFLDJ-UHFFFAOYSA-N
ID: 96438
SMILES:CC1=CC2C(C(C)(C)Oc3c(OC)cc(O)cc32)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.662
InChIKey:MTJFYDONBDGRHM-UHFFFAOYSA-N
ID: 96439
SMILES:c1(CCC)cc(O)c(C2C=C(C)CCC2C(C)(C)O)c(O)c1S(=O)(=O)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.494
CB1 binding score: -13.806
InChIKey:KINDKKIRERWZTC-UHFFFAOYSA-N
ID: 96440
SMILES:CC(c1c(-c2c(C)c3c(c(OC)c2OC)C=CC(C)(C)O3)cc2c(c1C)OC(C)(C)C1C2C=C(C)CC1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 516.722
CB1 binding score: -14.77
InChIKey:FORRHPNSFZTDSR-UHFFFAOYSA-N
ID: 96441
SMILES:c1c(CCc2cc(O)cc(OC)c2)cc(OC)c2c1OC1(C)C3C(C)(CCC1C(C)C)OC(C)(CC2)O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 510.671
CB1 binding score: -13.214
InChIKey:GYUCBGXISJHSLV-UHFFFAOYSA-N
ID: 96442
SMILES:CC1(C)Oc2c(c(O)cc(CCC)c2)-c2c(cc3c(c2O)C2(C)C(O)(C3)CCC(C)=CC1)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.603
CB1 binding score: -15.341
InChIKey:DZFOEXSSRBJKKL-UHFFFAOYSA-N
ID: 96443
SMILES:C1(C)(C)C2C(c3c(cc(CCCCCO)cc3O)O1)CC(C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -15.717
InChIKey:FMPVEUDGOLKFKZ-UHFFFAOYSA-N
ID: 96444
SMILES:C(Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -18.582
InChIKey:PDYKIGRVNVKGPA-UHFFFAOYSA-N
ID: 96445
SMILES:c1c(O)cc2c(c1CCCCC)OC(C)(C)C1C2CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.246
InChIKey:WZPPKJUMIYBLHX-UHFFFAOYSA-N
ID: 96446
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(C(C)C)CCC2(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.792
InChIKey:CHSHQAHJTCLTOJ-UHFFFAOYSA-N
ID: 96447
SMILES:C(CCCC)CCCCCc1cc(OC)cc2c1CC(C(=C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.567
CB1 binding score: -12.946
InChIKey:CHSSHXKUJRBKNN-UHFFFAOYSA-N
ID: 96448
SMILES:c1(CCCC)cc(O)c2c(c1O)C1C(C(C)(C)O2)CCC(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -13.577
InChIKey:DCEMYYSGBLQLDH-UHFFFAOYSA-N
ID: 96449
SMILES:c1(CC=C(C2CCC(=C)C3(C(CCC(C)CCO)(C)O3)C2)C)cc(O)ccc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -15.24
InChIKey:ASTBAULYRKFQGC-UHFFFAOYSA-N
ID: 96450
SMILES:C(CCCC)c1cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 96451
SMILES:Cc1cc2c(cc1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 96452
SMILES:c1(O)c2c(c(C(C(CC)C)=O)c(O)c1CCC(C)=O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -15.558
InChIKey:HDSKBADLKUPOOF-UHFFFAOYSA-N
ID: 96453
SMILES:c1(CCCCC)cc2c(c(O)c1)C1(CC=C(C)C)OC(C)(C)C(C1)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -16.015
InChIKey:OWZJMNJXJNBGTG-UHFFFAOYSA-N