ID: 133099
SMILES:c1(CCCCC)cc(O)c2c(c1)OC1CC(C)=CCCC(C)=CCC1(C)CCC2C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.696
CB1 binding score: -14.618
InChIKey:MLGVYCDHDTYYTP-UHFFFAOYSA-N
ID: 133100
SMILES:C1C(O)(C)CC2c3c(O)cc(CCCCC)cc3OC2(C)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.747
InChIKey:ROUYOYIVJMBZQS-UHFFFAOYSA-N
ID: 133101
SMILES:COc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.286
InChIKey:VBGLQLUQKZRKHZ-UHFFFAOYSA-N
ID: 133102
SMILES:C(C)CCc1c(OC)c(O)c2c(c1)OC(C)(C)C1CC=C(C(=O)OC)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -14.03
InChIKey:OGVHPXPXZURRTP-UHFFFAOYSA-N
ID: 133103
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(CO)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 133104
SMILES:C(C)(C12CCC(C)=CC1c1c(O)cc(CCCCC)cc1O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.928
InChIKey:SMTJUGXKTVNGCI-UHFFFAOYSA-N
ID: 133105
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(COC(=O)C(C=C)(C)O)(O)C(C)C1)C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.594
CB1 binding score: -14.256
InChIKey:UMCROJYNEIJCSU-UHFFFAOYSA-N
ID: 133106
SMILES:C12(O)CCC(C)=CC1C(O)(C=C(C)C)C(=O)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -12.485
InChIKey:SSUGJDFJHVPCCR-UHFFFAOYSA-N
ID: 133107
SMILES:CCCCCc1cc2c(c(O)c1)C1C(C(=C)C)CCC(C)(C2=O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.929
InChIKey:BPDUWXNLWMFOLR-UHFFFAOYSA-N
ID: 133108
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(COC(C)=O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -19.773
InChIKey:ILHSUWMZKIAMCQ-UHFFFAOYSA-N
ID: 133109
SMILES:C1CC(C(C)=C)C(c2c(O)c(OC)cc(CCN(C)C)c2)C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 329.484
CB1 binding score: -18.239
InChIKey:MTXSCIKNBFYXJI-UHFFFAOYSA-N
ID: 133110
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CCC(=C)C(CCc3cocc3)C1(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.663
CB1 binding score: -13.769
InChIKey:KUCJJVXEPLUKIT-UHFFFAOYSA-N
ID: 133111
SMILES:OC1C(C)(C)Oc2cc(CCCCC)cc(O)c2C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.348
CB1 binding score: -18.149
InChIKey:PWNRYJVNGXSCQW-UHFFFAOYSA-N
ID: 133112
SMILES:c1(CC=O)cc2c(c(O)c1)C1CC(C)(O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -16.433
InChIKey:OKKJAYNVVIALIZ-UHFFFAOYSA-N
ID: 133113
SMILES:c1(C)c(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c(C=O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -17.779
InChIKey:IPQSYTZZHONGEG-UHFFFAOYSA-N
ID: 133114
SMILES:C(CC(CCC(C)=CCC1CSCC(=C(C)CO)C1)C)Cc1cc(C(O)=O)ccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.654
CB1 binding score: -13.842
InChIKey:JMVBZPRTSGXVNV-UHFFFAOYSA-N
ID: 133115
SMILES:C(CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -19.71
InChIKey:SFWRRSGOJSILSQ-UHFFFAOYSA-N
ID: 133116
SMILES:C(=CCC1Oc2c(cc(C3C=C(C)CCC3C(C)=C)c(O)c2)O1)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -15.676
InChIKey:BQRKCAHZGDGGJC-UHFFFAOYSA-N
ID: 133117
SMILES:c1(O)c(C)c(O)c(-c2cc(C(C)(C)CC)[nH]c2C(C)C)c(O)c1Cc1c(CCCCC)cc2c(c1)OC(C)(C)C1CC=C(C)CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 641.937
CB1 binding score: -15.53
InChIKey:HJGLAJAEWXQRIO-UHFFFAOYSA-N
ID: 133118
SMILES:C12(C(C)=C)C(C3C(C)(CC1)C1CC3C(CCCCO)C1)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.679
CB1 binding score: -16.338
InChIKey:OYGNTPCXZZDOSJ-UHFFFAOYSA-N
ID: 133119
SMILES:C(C=C(C)C)CC(C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -19.572
InChIKey:KKASRYPDNSSAPZ-UHFFFAOYSA-N