ID: 10102
SMILES:c1(O)cc(CCCC)cc2c1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.879
InChIKey:IXZUQKJFDLWXNQ-UHFFFAOYSA-N
ID: 10103
SMILES:C(O)(C1CCC(C)=CC1c1cc(CCCCC)cc(O)c1)c1c(O)cc(O)c(CC=C(C)C)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.646
CB1 binding score: -14.851
InChIKey:AAXGBUIZXOAUCY-UHFFFAOYSA-N
ID: 10104
SMILES:C1=Cc2c(cc(CCC)cc2O)OC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 218.296
CB1 binding score: -17.978
InChIKey:CHBXMMKWGIOKEK-UHFFFAOYSA-N
ID: 10105
SMILES:c1c(CCCCC)cc2c(c1O)C=CC(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 10106
SMILES:C(CCCCCOc1c(O)c2c(c(OC(CCCCC)=O)c1C(C=C)C)OCO2)c1ccccc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.617
CB1 binding score: -16.138
InChIKey:YIJWTAQPHNWZGW-UHFFFAOYSA-N
ID: 10107
SMILES:C1(C(=O)C(C)C)CC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2CC(=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -14.951
InChIKey:GDKGUGNJNPPPCA-UHFFFAOYSA-N
ID: 10108
SMILES:C1CC(C)(C)OC(c2c(CCCCC)cc3c(c2O)OC(C)(C)C=C3)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.72
InChIKey:HNJUAKGPXUBMSM-UHFFFAOYSA-N
ID: 10109
SMILES:C12=C(C=CC(=C)CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.464
CB1 binding score: -16.488
InChIKey:DECUTFJSNGOTOU-UHFFFAOYSA-N
ID: 10110
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 10111
SMILES:c1c2c(c(C)cc1)-c1c(O)cc(CCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -16.048
InChIKey:PUUIWPLBLSKNBM-UHFFFAOYSA-N
ID: 10112
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C1(C)CCC1C(C)(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.479
InChIKey:CYOSQQPUWBQSPW-UHFFFAOYSA-N
ID: 10113
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -16.433
InChIKey:OKKJAYNVVIALIZ-UHFFFAOYSA-N
ID: 10114
SMILES:C1CC(C)=CC2C(C(C)(C)Oc3c4c(cc(O)c32)C(=O)N(CCO)C4)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 411.542
CB1 binding score: -15.604
InChIKey:TZIUAMFXHJAFQO-UHFFFAOYSA-N
ID: 10115
SMILES:c1(CCCCC)cc2c(c(O)c1C(OCC)=O)C1CC(C)(O2)CCC1C(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -17.37
InChIKey:DLZBBFZUPZCJLV-UHFFFAOYSA-N
ID: 10116
SMILES:C(C)CCCCc1cc2c(c(O)c1)OC1(C)C(C2)C(C)(C)C2C1(O)CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -16.015
InChIKey:MMOKNBWPLDNDHF-UHFFFAOYSA-N
ID: 10117
SMILES:CC(=O)CCCC1(C)C(O)Cc2c(O)cc(CCC(C)(O)C)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.455
CB1 binding score: -12.662
InChIKey:JBHFUZKCXCWUOH-UHFFFAOYSA-N
ID: 10118
SMILES:O1c2cc(CCCCC)c(C(=O)O)c3c2C(C(C)(C)C3=O)C(O)CC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -16.026
InChIKey:VGEHSDKJZVYFCE-UHFFFAOYSA-N
ID: 10119
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 10120
SMILES:C1C(C)(C)C2=C(c3c(O)cc(CCCCC)cc3OC2(C)C)C2=C(C1)C(O)C(C)(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -13.56
InChIKey:WWOHEBPZIXSVDT-UHFFFAOYSA-N
ID: 10121
SMILES:C1C=CC(O)(C)CC1c1c(O)cc(CCCCC)cc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: Not available
InChIKey:FFQUZMAYNKFWOT-UHFFFAOYSA-N
ID: 10122
SMILES:OCc1cc2c(c(OC)c1)C=CC(CCC=C(CCC=C(C)C)C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -17.692
InChIKey:WOALEOPYGCGJDV-UHFFFAOYSA-N