ID: 139210
SMILES:C1C(C(=C)C)C(c2c(C#C)c(O)c(Br)c(C)c2)C=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 345.28
CB1 binding score: -12.671
InChIKey:AHUHNWVCPVAZKM-UHFFFAOYSA-N
ID: 139211
SMILES:C(c1cc(C=O)c(O)c2c1OC(C)(C)C1C2CC(C)=CC1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.924
InChIKey:GTUIYYOLUSOQPF-UHFFFAOYSA-N
ID: 139212
SMILES:C(CC)CCc1cc(O)c2c3c1C1(OC)CC(C)=CCC1C(C)(C)OC(C)(C)C3CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.641
CB1 binding score: -16.812
InChIKey:KCRRYCGZYBQRSI-UHFFFAOYSA-N
ID: 139213
SMILES:C1C2(C)C3(O)C(C(C)=C)C(=O)CC(C)C3=CC(=O)C1(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.591
CB1 binding score: -15.436
InChIKey:LTVBDLRMECFFFJ-UHFFFAOYSA-N
ID: 139214
SMILES:C12C(C)(C)Oc3cc(CCCCC)cc(O)c3C1=C(C(=O)CC(C)C)C1OC1(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -15.536
InChIKey:BAKOIGPFVHKQNG-UHFFFAOYSA-N
ID: 139215
SMILES:CC(C(C(=O)O)c1c(O)c(C=O)c(O)c(C2C=C(C)CCC2C(C)=C)c1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.417
CB1 binding score: -14.781
InChIKey:TWUHLVMYCLBYAG-UHFFFAOYSA-N
ID: 139216
SMILES:C(C=C(CCC=C(C)C)C)CC(=CCc1c(O)cc(CCCCC)cc1OC(=O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.641
CB1 binding score: -17.817
InChIKey:DOBIHFILNCXYQS-UHFFFAOYSA-N
ID: 139217
SMILES:CC1=CCC2C(C)(C)Oc3c(C(=O)C(C)C)c(O)cc(CC=CC(=C)C)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.528
CB1 binding score: -16.488
InChIKey:SAJGDHYCSTVQBX-UHFFFAOYSA-N
ID: 139218
SMILES:CCCCCc1cc(O)cc(O)c1C1CC(C)CCC1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -18.753
InChIKey:BHQDJFJOVJDCDO-UHFFFAOYSA-N
ID: 139219
SMILES:C1(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 139220
SMILES:c1c(O)cc2c(c1OC)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.527
InChIKey:QGMOAJVZFIQWPU-UHFFFAOYSA-N
ID: 139221
SMILES:CC1(C)C2C(c3c(cc(CCCCC)cc3OC)C(=O)C1)C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -14.605
InChIKey:QHCYFPKFKSYFQI-UHFFFAOYSA-N
ID: 139222
SMILES:C12C(C)CCC1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.029
InChIKey:HCVJHHUJBXZYBI-UHFFFAOYSA-N
ID: 139223
SMILES:CC(C)=CCc1c(O)c(-c2c(OC3C(C(C)C)CCC(C)=C3)c(CCCCC)cc(O)c2)cc(CC=C(C)C)c1OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 574.846
CB1 binding score: -16.655
InChIKey:XBCJEKPFVHNSSH-UHFFFAOYSA-N
ID: 139224
SMILES:Cc1c(O)c(CC=C(C)CCC=C(C)C)c(O)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.74
InChIKey:NDCNAGIHMAFCOX-UHFFFAOYSA-N
ID: 139225
SMILES:NCCCNC(=O)CC(c1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.536
CB1 binding score: -15.503
InChIKey:LYFMXXIMXWSBME-UHFFFAOYSA-N
ID: 139226
SMILES:Oc1cc2c(c(OC)c1)C1C(=C(C)CCC1C(=C)C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -14.543
InChIKey:OBMGJAUZNBCBMB-UHFFFAOYSA-N
ID: 139227
SMILES:CC1(C)C2CC=C(C(O)=O)CC2c2c(O)cc(CCCCC)cc21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.519
InChIKey:KVYLEEURLSYSOH-UHFFFAOYSA-N
ID: 139228
SMILES:C1C(C(C)CCC=C(C)C)c2c(O)cc(CCCO)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -15.288
InChIKey:YPJDAROFCSBIOW-UHFFFAOYSA-N
ID: 139229
SMILES:Oc1c(C(OC)=O)c(CCCCCOC(C)CCc2ccccc2)c2c(c1O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 536.709
CB1 binding score: -13.382
InChIKey:CTCMDHQUIMRRGM-UHFFFAOYSA-N
ID: 139230
SMILES:C(=O)CCCc1cc2c(c(O)c1)C1C(C(C)=C)CCC(C)=CC1OC2=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.446
CB1 binding score: -16.351
InChIKey:JFRZBQNWUCNBKP-UHFFFAOYSA-N