ID: 54139
SMILES:O1C(CC=CC(C)(C)O)(C)CCc2c(O)c(C(O)=O)c(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -17.144
InChIKey:HONZFBORARTUQJ-UHFFFAOYSA-N
ID: 54140
SMILES:CC(=CCCC1=CC(c2c(O)cc(CCCCC)cc2O)OC1=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.854
InChIKey:ZGNBDHDIIXUCDX-UHFFFAOYSA-N
ID: 54141
SMILES:O=C1C2C(C(C)(C)Oc3c(c(O)cc(CCCCCC)c3)C2)C2C(O)C(C)=CCC2(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -14.701
InChIKey:CIBFMTDTEZBZAD-UHFFFAOYSA-N
ID: 54142
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.329
InChIKey:OGTYERSWJNGKFK-UHFFFAOYSA-N
ID: 54143
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1=CC(=O)C(C)(O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.502
InChIKey:GLSYAEMXTWVJQP-UHFFFAOYSA-N
ID: 54144
SMILES:CC1C2C(O)(c3c(cc(CCCCC)cc3O)OC2(C)C)C(=O)C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.717
InChIKey:IURAWOYOLQVXNP-UHFFFAOYSA-N
ID: 54145
SMILES:O=C1C(C2(C)C(C)C3(CI)Oc4c(c(O)cc(CCC)c4)C3)(CC1)OC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.347
CB1 binding score: -17.811
InChIKey:ZWYYEOZNGPSGGN-UHFFFAOYSA-N
ID: 54146
SMILES:c12c(c(O)cc(CCCCC)c1)C1C=C(C=O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.053
InChIKey:HQRKNUDGMPVIMO-UHFFFAOYSA-N
ID: 54147
SMILES:Oc1c2c(cc(C)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 54148
SMILES:C(Cc1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1)C(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 318.413
CB1 binding score: -18.016
InChIKey:OVJKPQKAIHSVBC-UHFFFAOYSA-N
ID: 54149
SMILES:Oc1c2c(cc(CCCCC)c1-c1c(O)cc3c(c1OC)OC(C)(C)C1C3C=C(C)CC1)C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.657
CB1 binding score: -14.24
InChIKey:CQVUCYKICMIZDL-UHFFFAOYSA-N
ID: 54150
SMILES:C1(C(=C)C)CCC(C)=CC1c1c(O)cc(CC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.786
InChIKey:YURJBXYTSFIOOT-UHFFFAOYSA-N
ID: 54151
SMILES:CC1(C)Oc2c(c(O)cc(CCc3ccccc3)c2)C2(C)C3C1CCC(O)(C)C3C(C)CC2OC(C)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.683
CB1 binding score: -14.463
InChIKey:DMBNHRFDAVIEOZ-UHFFFAOYSA-N
ID: 54152
SMILES:c1(CC=C(CCC=C(C)C)CO)c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.652
InChIKey:YGSDIXSCKNPHAP-UHFFFAOYSA-N
ID: 54153
SMILES:C1C(C)=CCCC1(C)CCOc1cc(CCCCC)cc(OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.933
InChIKey:SEVKOWKZKYPVNC-UHFFFAOYSA-N
ID: 54154
SMILES:c1(O)cc(C)c2c(c1CCCCC)CC(C=CC=C(CCC=C(C)C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.326
InChIKey:UZTHHZKCYFUTRE-UHFFFAOYSA-N
ID: 54155
SMILES:O=C(C)c1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -17.946
InChIKey:QCIXEVPAXBMYJY-UHFFFAOYSA-N
ID: 54156
SMILES:c1(CCCC)cc2c(c(O)c1)OC(CCC=C(C)C)(C)C1C2CCC(C(=O)O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -15.598
InChIKey:KZAUWXQXVISMKD-UHFFFAOYSA-N
ID: 54157
SMILES:C12C(c3c(O)cc(CCCCC)cc3O1)C(O)C(C)(C)OCO2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.401
CB1 binding score: -15.506
InChIKey:YZLCRIXWLOOHHC-UHFFFAOYSA-N
ID: 54158
SMILES:c1(O)c2c(c(C=O)c(CCCCC)c1)OC1(C)OC2C(C)(C)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -14.29
InChIKey:BISUYJABERHYCN-UHFFFAOYSA-N
ID: 54159
SMILES:C12(C)CCC3C(C)(C)Oc4c(c(O)cc(CCCCC)c4)C3C1C=C(CO)CCC2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -12.596
InChIKey:BZQOEHMIZAONJJ-UHFFFAOYSA-N