ID: 117496
SMILES:C12CCC(C)=CC1c1c(cc(CCCCC)cc1O)OC(C)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.165
InChIKey:MUXHYALLLRVRCD-UHFFFAOYSA-N
ID: 117497
SMILES:C1(C)=CC(c2c(OC)cc(CCCCC)cc2OC(C)(C)C=C)OC(CO)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -15.751
InChIKey:MSIWBFNGZOFELN-UHFFFAOYSA-N
ID: 117498
SMILES:C(c1c(O)cc(CCCCC)cc1OC)C=C(C)CCC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 398.631
CB1 binding score: -18.943
InChIKey:QOVOSRUONCHPIN-UHFFFAOYSA-N
ID: 117499
SMILES:C(=CC(=O)CC(CC)(C)C)C1CCC(C)=CC1c1c(O)cc(CCC)c(C=O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -14.736
InChIKey:XYFISORYGJSLNB-UHFFFAOYSA-N
ID: 117500
SMILES:c1(C(CC(C)C)=O)c(O)c(C2C(C(C)=C)CCC(C)=C2)ccc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.279
InChIKey:ADSBNSOLDWQMRX-UHFFFAOYSA-N
ID: 117501
SMILES:C1(C)(C)Oc2c(c(OC(=O)C)cc(CCNCCCC)c2)C2C=C(C)CCC21O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 401.547
CB1 binding score: -14.399
InChIKey:LFVIKHRBTANEAW-UHFFFAOYSA-N
ID: 117502
SMILES:Oc1c(C2C=C(C)CC(O)C2C(C)=C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.955
InChIKey:UKTDGUHOBZBFHV-UHFFFAOYSA-N
ID: 117503
SMILES:C1(C(=C)C)C(c2c(O)cc(CCCCC)cc2OC)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.302
InChIKey:IPGGELGANIXRSX-UHFFFAOYSA-N
ID: 117504
SMILES:CC1(C)C2CC=C(C=O)C(O)C2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.125
InChIKey:DNINQNUQQRRAMJ-UHFFFAOYSA-N
ID: 117505
SMILES:c1(O)c2c(cc(CCCCC)c1)OC1(C)C2C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.251
InChIKey:GIVNWDNDDALTHM-UHFFFAOYSA-N
ID: 117506
SMILES:C1CC(C=C)(C)Oc2cc(CCCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -14.871
InChIKey:YULXJQPHECUUQD-UHFFFAOYSA-N
ID: 117507
SMILES:C1(C)CC(c2c(O)cc(CC)cc2O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.576
InChIKey:KDHXYFWLRPWCCH-UHFFFAOYSA-N
ID: 117508
SMILES:C(CCc1cc(OC)c2c(c1)OC(C)(C)C(CC1=C(O)C(O)CCC2=O)C1=O)CCCCCN
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 473.61
CB1 binding score: -14.783
InChIKey:FLQQVPXRVCOEFH-UHFFFAOYSA-N
ID: 117509
SMILES:c1(C(C)(C)C(=O)C)cc(O)c2c(c1)OC(C)(C)C1C2CC(=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -13.454
InChIKey:ANFNRGZTORJHDY-UHFFFAOYSA-N
ID: 117510
SMILES:c12cc(CCCCC)cc(O)c1C1C(C(=C)C)CCC(C)(C1)C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.551
CB1 binding score: -15.353
InChIKey:BHXVLPAQIAZCRV-UHFFFAOYSA-N
ID: 117511
SMILES:C(CCC(C)=CCc1cc(O)c(CC(O)CC)cc1O)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.998
InChIKey:MSECQLJZISRSLW-UHFFFAOYSA-N
ID: 117512
SMILES:c1(CCCCC)cc2c(c(OC(=O)C(C)C)c1)C1C3(C)C(C(C)(C)CCC1)C(=O)C23O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -14.399
InChIKey:GUYCXATWZCZDBC-UHFFFAOYSA-N
ID: 117513
SMILES:C1c2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.339
CB1 binding score: -18.796
InChIKey:BFFUWWHIAIGFJU-UHFFFAOYSA-N
ID: 117514
SMILES:C12(C(C)(C)Oc3cc(CCCCC)cc(O)c31)CCC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.228
InChIKey:XQYSGOVDVJLJAU-UHFFFAOYSA-N
ID: 117515
SMILES:CC1(C)C2C(C)(CC(c3c(O)cc(CCCCC)cc3OC(C)(C)C=C)=C2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -17.827
InChIKey:VQZXDCJOWKZSHZ-UHFFFAOYSA-N
ID: 117516
SMILES:Oc1cc(CCCCC)cc2c1C1C(=C(C)CCC1C(=C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -17.644
InChIKey:IEERHDNDIMSELQ-UHFFFAOYSA-N