ID: 32089
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 32090
SMILES:C1(CO)=CC2c3c(cc(CCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.9
InChIKey:UWBCYGUAEGZJRC-UHFFFAOYSA-N
ID: 32091
SMILES:CCCCCc1c(O)cc(O)c(CC=C(C)CCC=C(C)C)c1
Pathway: Polyketides
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 316.485
CB1 binding score: -17.394
InChIKey:MYUUBTAELPINEG-UHFFFAOYSA-N
ID: 32092
SMILES:CC12C(C(C(=C)C)CC1)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.819
InChIKey:KAMBAVCQZNPQOI-UHFFFAOYSA-N
ID: 32093
SMILES:c1c(O)ccc(C(=CC(=O)C(CCCCCC)C2=C(O)C3(C4C(CCC(C)=CC4)C(C)(C)O3)CC2=O)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 536.709
CB1 binding score: -17.196
InChIKey:FSQUMWRDIADKDK-UHFFFAOYSA-N
ID: 32094
SMILES:O(C(=O)C)CC1=CC2c3c(cc(C=CC(=O)C)c(C=O)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.455
CB1 binding score: -15.46
InChIKey:ZEKHRTJVRRPFMC-UHFFFAOYSA-N
ID: 32095
SMILES:c12c(cc(CCCCC)cc1O)C=CC(CCC=C(C)CO)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.813
InChIKey:LSARTHGYPRKEPU-UHFFFAOYSA-N
ID: 32096
SMILES:C(=O)(C1=CC2C(C=C1)C(C)(C)Oc1c2c(OC)cc(CCCCC)c1)NC(C(C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 425.569
CB1 binding score: -15.609
InChIKey:SMTYAVJWWZMBAQ-UHFFFAOYSA-N
ID: 32097
SMILES:C1(=O)C(C)=CC2c3c(O)cc(CCCCC)c(Cl)c3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.897
CB1 binding score: -13.498
InChIKey:TWLUQVQOFXVARG-UHFFFAOYSA-N
ID: 32098
SMILES:C1CCC(CCCC(C)C)(C)Oc2cc(CCCCC)c(O)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Prenyl quinone meroterpenoids
MW: 332.528
CB1 binding score: -15.354
InChIKey:QMSAKSBHTNTJAP-UHFFFAOYSA-N
ID: 32099
SMILES:O=C(O)CCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -21.025
InChIKey:CUXNLZIJHQOPIO-UHFFFAOYSA-N
ID: 32100
SMILES:C1(C(CO)C)CC(C(=C)C)C(c2c(O)cc(O)cc2CCCCC)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16
InChIKey:YIJSDHYWOQPWQM-UHFFFAOYSA-N
ID: 32101
SMILES:CC1=Cc2c(O)cc(CCCCC)cc2C(O)C12C(=O)C(C)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -13.127
InChIKey:RNRHQPLHAGVZQN-UHFFFAOYSA-N
ID: 32102
SMILES:c12c(cccc1O)OC(CO)(C)C1C2CCC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.322
CB1 binding score: -18.103
InChIKey:SSEGQVLXEUVYGA-UHFFFAOYSA-N
ID: 32103
SMILES:C(C=C(C)C)CC1(C)C2CCC(C)=CC2c2c(cc(CCCCC)c(C(OC)=O)c2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -16.779
InChIKey:JOFPAEDISLTFDC-UHFFFAOYSA-N
ID: 32104
SMILES:C1c2c(O)cc(C)cc2OC(C)(C)C(O)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -16.499
InChIKey:GFXQLBXROTZHGZ-UHFFFAOYSA-N
ID: 32105
SMILES:C(=C)(C)C1CCC(C)=CC1c1c(OC)cc(O)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.218
InChIKey:UZWBOVFGUISXLX-UHFFFAOYSA-N
ID: 32106
SMILES:c1(O)cc(CCCC)cc2c1OC(CCC=C(C)C)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.131
InChIKey:JSFVSOFLFYHGTE-UHFFFAOYSA-N
ID: 32107
SMILES:OC1C(CCC=C(C)C)(C)Oc2cc(CCC)cc(O)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -17.686
InChIKey:LLPMAUMTANBRBH-UHFFFAOYSA-N
ID: 32108
SMILES:o1c(CCCCC)cc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.346
InChIKey:SAUXKDLKKADDDO-UHFFFAOYSA-N
ID: 32109
SMILES:C(CCc1cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.687
InChIKey:RGXKCMQANRHRCO-UHFFFAOYSA-N