ID: 42106
SMILES:C(C(=O)O)Cc1cc(CC=C(C)CCC=C(C)C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.64
InChIKey:JJRKAQIZHVDOFJ-UHFFFAOYSA-N
ID: 42107
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(=C)C)CCC1(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -17.596
InChIKey:RWFIRVYASWVANS-UHFFFAOYSA-N
ID: 42108
SMILES:O(CCCCCC)c1c2c(c(OC)c(C)c1)OC(CCC=C(C)C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.668
CB1 binding score: -13.23
InChIKey:QPSHDNWJYWTRDS-UHFFFAOYSA-N
ID: 42109
SMILES:C1(C)=CC(c2c(O)c(CC=C(C)CCC=C(C)C)c(O)c(C(=O)CCCCC)c2)C(C(C)(C)O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.732
CB1 binding score: Not available
InChIKey:LOXFQROCPUPAEB-UHFFFAOYSA-N
ID: 42110
SMILES:C1(O)Oc2c(c(O)cc(CCCCC)c2)C2=CC(C)(C)OC12C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -15.507
InChIKey:HFYXPJRAROXHPF-UHFFFAOYSA-N
ID: 42111
SMILES:C12OC(C)CCC1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.814
InChIKey:ZOPZXHOKTNOOGB-UHFFFAOYSA-N
ID: 42112
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(COC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.928
InChIKey:MKTVKZAXRKQUPR-UHFFFAOYSA-N
ID: 42113
SMILES:O(C(C)=O)C1CCC(O)(C)C(c2c(OC(C)=O)cc(CCCCC)cc2)C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -12.98
InChIKey:SRVYWIIJSQFXRT-UHFFFAOYSA-N
ID: 42114
SMILES:C(C)(C)=CCCC(C1CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2C1)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -17.466
InChIKey:MQEKPEGAQGUSKG-UHFFFAOYSA-N
ID: 42115
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.27
InChIKey:WPJGAEFIBVPIDI-UHFFFAOYSA-N
ID: 42116
SMILES:c1(CCCC)cc2c(c(O)c1)C1CC(C)(OCC1C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -17.093
InChIKey:JCRAPUNHUQHDCW-UHFFFAOYSA-N
ID: 42117
SMILES:C1C2c3c(cc(CCCCC)cc3O1)OC(C)(C)C1C2CC(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.628
InChIKey:NRSJIDOGAXJKBZ-UHFFFAOYSA-N
ID: 42118
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2C(O)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.898
InChIKey:SUVXTOCRTNYFMQ-UHFFFAOYSA-N
ID: 42119
SMILES:OC1C(O)C(O)C(CO)OC1Oc1cc(CCCCC)cc2c1C1C=C(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.609
CB1 binding score: -15.929
InChIKey:YNVKKBOBYBGTKC-UHFFFAOYSA-N
ID: 42120
SMILES:c1(CCC)cc(O)c2c(c1)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.9
InChIKey:UWBCYGUAEGZJRC-UHFFFAOYSA-N
ID: 42121
SMILES:OC(C)(C)C1C2c3c(cc(CCCCC)cc3O1)OC(C)(C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -15.791
InChIKey:XZZCCRUILWLNKO-UHFFFAOYSA-N
ID: 42122
SMILES:C(C)CC(c1cc(O)c2c(c1)OC(C)(C)C1CCC(COC(=O)C)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -13.876
InChIKey:RZGOULZWNGIXNF-UHFFFAOYSA-N
ID: 42123
SMILES:C(CN)Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 317.429
CB1 binding score: -15.517
InChIKey:LWQVQRBAINVMBL-UHFFFAOYSA-N
ID: 42124
SMILES:O1C2(C(C)CC(O)C3C(C)(C)CCCC23C)Oc2c1c(OC)cc(CCCCC)c2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -14.336
InChIKey:NIIOPDSJIZDADC-UHFFFAOYSA-N
ID: 42125
SMILES:OC(=O)C=C(CO)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.38
CB1 binding score: -14.88
InChIKey:HSBQTUKMPJAXMH-UHFFFAOYSA-N
ID: 42126
SMILES:Oc1c2c(cc(C(C)CCl)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.86
CB1 binding score: -15.998
InChIKey:MBMBRNXBXUVWTB-UHFFFAOYSA-N