ID: 123124
SMILES:c1(OC)c(O)c(C2C=C(C)CCC2C(C)=C)c(O)cc1OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -16.438
InChIKey:RORNPBCSAFDWPM-UHFFFAOYSA-N
ID: 123125
SMILES:CC(=CCc1c(O)cc(CC(CCC=C(C)C)=C)c(O)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.67
InChIKey:DGVMACKIWSOJLW-UHFFFAOYSA-N
ID: 123126
SMILES:C1(=O)CC(c2cc(O)ccc2O)C(C(C)=O)C(CC=CC(O)(C)C)(C)C1(C)CO
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.503
CB1 binding score: -13.305
InChIKey:OOMPWKQCXOZBJC-UHFFFAOYSA-N
ID: 123127
SMILES:C1(C)(C)C2Cc3c(OC)cc(CCCCC)cc3OC2(C)CCC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.936
InChIKey:MBLABEJDSVQROM-UHFFFAOYSA-N
ID: 123128
SMILES:c1(C2C(C(C)=C)CCC(C)=C2)cc(O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.048
InChIKey:FUZJMTMPVZRGQF-UHFFFAOYSA-N
ID: 123129
SMILES:C1(C)(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: 123130
SMILES:c1(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 123131
SMILES:C(C=C(C)C)Cc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -17.493
InChIKey:BFPXFAHDYHTBOO-UHFFFAOYSA-N
ID: 123132
SMILES:C(CC(C)=O)C1(CC=C(C)CC=CC(O)(C)C)C(O)CCC(=O)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.703
CB1 binding score: -16.587
InChIKey:KDIIHKYDFYQCCD-UHFFFAOYSA-N
ID: 123133
SMILES:CCCCCc1cc(O)c(C2C=C(C)CCC2C(COC2OC(CO)C(O)C(O)C2O)C)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.625
CB1 binding score: -16.799
InChIKey:OIYFJYSVIBZWOA-UHFFFAOYSA-N
ID: 123134
SMILES:CC1(C)C2CCC(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 123135
SMILES:C(C)CCCCc1cc(O)c2c(c1)OC(C)(C)C1=C2C(=O)C(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.635
InChIKey:IWMKROSWYFSTEY-UHFFFAOYSA-N
ID: 123136
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 123137
SMILES:C1C(C(C)(C)O)Oc2c1ccc(CCCCC)c2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -18.316
InChIKey:GOOVIKRDBAWBMD-UHFFFAOYSA-N
ID: 123138
SMILES:C1(C)=CC(c2c(O)cc(CCC)cc2O)C(C(CCC=C(C)C=O)(O)C)CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -18.432
InChIKey:NNXSGCSCFVDXRC-UHFFFAOYSA-N
ID: 123139
SMILES:COC1C(=C)CCC(C(C)=C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -1.303
InChIKey:YGBCBOHNBFQMAF-UHFFFAOYSA-N
ID: 123140
SMILES:c1(CCCCC)cc(O)c(C2CC(C(=C)C)CC(CC=C(C)C)C2(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Polyprenylated cyclic polyketides (Hop meroterpenoids)
MW: 398.631
CB1 binding score: -16.845
InChIKey:ZUPQDXAWKNBBND-UHFFFAOYSA-N
ID: 123141
SMILES:Oc1cc(CC)cc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.585
InChIKey:DNTBFILTGOCICF-UHFFFAOYSA-N
ID: 123142
SMILES:C12C=C(C)C(O)CC1C(C)(C)Oc1c2cc(O)c(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 274.36
CB1 binding score: -17.694
InChIKey:KDZKTWRIFRUSPJ-UHFFFAOYSA-N
ID: 123143
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 123144
SMILES:c1(CCS(=O)(=O)C)cc(C2C=C(C)CCC2C(C)=C)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.481
CB1 binding score: -16.43
InChIKey:BZIJEJRWZCDXCQ-UHFFFAOYSA-N