ID: 125161
SMILES:CC1C(O)C=C2C(C)(C)Oc3cc(CCCO)cc(O)c3C2C1Br
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 397.309
CB1 binding score: -13.629
InChIKey:ZFVXVEYFVMIKOD-UHFFFAOYSA-N
ID: 125162
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 125163
SMILES:OC(=O)C(=C)CCOc1c2c(cc(C)c1-c1c(O)cc(CCCCC)cc1OC)OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 548.72
CB1 binding score: -15.137
InChIKey:IZOWOKFOQQUWQW-UHFFFAOYSA-N
ID: 125164
SMILES:O=C(OC1CC2C(C)(C)Oc3c(c(O)cc(C(C(C)OC(=O)C)C)c3)C2C2C3(C)OC3CC2C1C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 500.632
CB1 binding score: -12.831
InChIKey:LZIFVGZJTWRFIW-UHFFFAOYSA-N
ID: 125165
SMILES:C(C)(OC(CC(C)=CCCC1(C)C=Cc2c(c(C)cc(O)c2)O1)O)=CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.167
InChIKey:GTXFGKRZTVMENZ-UHFFFAOYSA-N
ID: 125166
SMILES:c1(O)cc(C)cc(O)c1C1C=C(C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.979
InChIKey:GKVOVXWEBSQJPA-UHFFFAOYSA-N
ID: 125167
SMILES:CC(=CCc1c(O)cc(CCC)cc1O)CCC=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 356.55
CB1 binding score: -18.934
InChIKey:LDZQKZLPWVBJOB-UHFFFAOYSA-N
ID: 125168
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 125169
SMILES:C12C(C(C)CC1)C(OC1OC(CO)C(O)C(O)C1O)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.544
CB1 binding score: -12.166
InChIKey:TUTRQVSKPORBSK-UHFFFAOYSA-N
ID: 125170
SMILES:C1C(C(=C)C)C(c2c(O)cc(CCC)cc2OC)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -18.099
InChIKey:NBMJMYIBJIBJAJ-UHFFFAOYSA-N
ID: 125171
SMILES:C1C(C)=CCC1C1(C)C(Cc2cc(O)cc(C)c2O)OC(C)(C)C1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -13.068
InChIKey:QHPGBHCVSSVUCQ-UHFFFAOYSA-N
ID: 125172
SMILES:Oc1c(CC=C(C)CCC=C(C)C)c(OC(C)=O)cc(COC(=O)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -17.474
InChIKey:GIUMDPCVMGJEDV-UHFFFAOYSA-N
ID: 125173
SMILES:C1(C)(C)Oc2cc(C)cc(O)c2C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 125174
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(C1=O)CC(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -15.012
InChIKey:NVFGFOBMNLYUAA-UHFFFAOYSA-N
ID: 125175
SMILES:C(C(CC)C)(c1c(O)c2c(c(O)c1)OC(C)(C)C1(C2)C(C(C)=CC)O1)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -13.074
InChIKey:XSMYFIMYMJOQLQ-UHFFFAOYSA-N
ID: 125176
SMILES:C(=CCCC(C1COc2c(cc(CCCCC)cc2O)C1O)C)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -13.407
InChIKey:WJMNJVDZXDSSEX-UHFFFAOYSA-N
ID: 125177
SMILES:O(c1cc(CCCCC)cc(O)c1CC=C(C)CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 125178
SMILES:C(C)(O)(C1CCC(C)=CC1c1c(O)cc(CC=CC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -18.313
InChIKey:HKFJRVMWZKIJDE-UHFFFAOYSA-N
ID: 125179
SMILES:c1c(CC2C(C(C)C)CCC(C)=C2)cc(CCCCC)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.514
CB1 binding score: -11.37
InChIKey:WPSFANDQTGBPBO-UHFFFAOYSA-N
ID: 125180
SMILES:C(=C(C(O)=O)C)CCC(C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -18.723
InChIKey:WJFILTHPTPTQEA-UHFFFAOYSA-N
ID: 125181
SMILES:CC(CCC=C(C)C)=CCc1cc(OC(=O)C)cc(C)c1OC(C)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.334
InChIKey:RAISXEOPUCKKJW-UHFFFAOYSA-N