ID: 51220
SMILES:Oc1cc(CCCCC)cc2c1C1OC(CCC=C(C)C)(C)C1CC(=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -14.187
InChIKey:HLTFXBYOYINQPE-UHFFFAOYSA-N
ID: 51221
SMILES:CC1(C)CCCC2(C)c3c(O)c(O)c(C)cc3OC(C)(C)C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -18.067
InChIKey:HKZIZFCXYHOESA-UHFFFAOYSA-N
ID: 51222
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -17.64
InChIKey:NLNTYNQQFDNDTM-UHFFFAOYSA-N
ID: 51223
SMILES:C(Cc1cc(C2C(C(C)=C)CCC(C)=C2)c(C)cc1O)=CCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.481
CB1 binding score: -14.793
InChIKey:BOKRSNUPWQBPJR-UHFFFAOYSA-N
ID: 51224
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -21.078
InChIKey:LXIXAVCVBZBXIY-UHFFFAOYSA-N
ID: 51225
SMILES:C1(CC(=O)CC(C)C)(C)C=Cc2c(O)c(C(=O)O)c(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -15.372
InChIKey:MQUBXFCOAQTKBP-UHFFFAOYSA-N
ID: 51226
SMILES:CC1(C)C(Cc2c(O)cc(CCCCC)cc2O)C(=C)CCC1C(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.565
CB1 binding score: -12.588
InChIKey:KPQFLMHHUWKDLS-UHFFFAOYSA-N
ID: 51227
SMILES:C(O)C1(C)CC(c2c(O)cc3c(c2O)C2C(=O)C(C)(C)OC2(C)O3)C=C(CCC=C(C)C)C(O)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.577
CB1 binding score: -13.542
InChIKey:PILNPOQGXJWKAU-UHFFFAOYSA-N
ID: 51228
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1C(C(C)(C)O2)CCc2cc(O)c(C)c(C)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -14.42
InChIKey:KTGPTBCHZIUGSN-UHFFFAOYSA-N
ID: 51229
SMILES:c1(C(C)=O)cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -17.834
InChIKey:MKEBYMYEFFKCQH-UHFFFAOYSA-N
ID: 51230
SMILES:C(C1Cc2c(C)c(O)cc(-c3c(O)cc(CCCCC)cc3O)c2C2C1CC2(C)C)(=O)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.591
CB1 binding score: -16.172
InChIKey:QJANXLDLCQMEQS-UHFFFAOYSA-N
ID: 51231
SMILES:C1C(C)CCC2=C1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.622
InChIKey:NEBZNJDFIPBXCS-UHFFFAOYSA-N
ID: 51232
SMILES:C1=C(CO)CCCC(C)(C=CC=C(C)C)Oc2c(c(O)cc(CCC)c2)-1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.12
InChIKey:JDMGFKIKHLXWSI-UHFFFAOYSA-N
ID: 51233
SMILES:C(C)OC(CC(C)C=Cc1cccc2c1C1C(C(C)(C)O2)CCC(C)=C1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -16.537
InChIKey:LSVLQJIPIGIUQV-UHFFFAOYSA-N
ID: 51234
SMILES:C1(OC(C)=O)C(C)(C)Oc2cc(CCCCC)cc(O)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -16.872
InChIKey:LILVZBSIHBDNJN-UHFFFAOYSA-N
ID: 51235
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(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: 51236
SMILES:C1CC(C)(C)C2C(c3c(cc(CCCCC)cc3O)O2)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.588
InChIKey:ZHQYKTMGTDKCPG-UHFFFAOYSA-N
ID: 51237
SMILES:Oc1c2c(cc(OC)c1OC)OC(C)(C)C1CC=C(C)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -16.875
InChIKey:XVMIPGCSUKRWRY-UHFFFAOYSA-N
ID: 51238
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.096
InChIKey:OPOIPENSMKDQLW-UHFFFAOYSA-N
ID: 51239
SMILES:O=C(C)OOC(C)(C)CCCC(C)=CCCC(=CCc1cc(O)c(CC(OC)=O)cc1O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.583
CB1 binding score: -12.749
InChIKey:SQQQYIVAUUREFS-UHFFFAOYSA-N
ID: 51240
SMILES:Oc1c(C(C(C)C)=O)c2c(c(CCCCC)c1)OC(C)(C)C1C2CC(C(=O)OC)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -14.041
InChIKey:YWFXMFVOMKHSEL-UHFFFAOYSA-N